U2H
Summary
Name: | ~{N}-methyl-~{N}-[(5-phenylmethoxy-1~{H}-indol-3-yl)methyl]propan-1-amine |
Formula: | C20 H24 N2 O |
Formal charge: | 0 |
Formula weight: | 308.417 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-methyl-~{N}-[(5-phenylmethoxy-1~{H}-indol-3-yl)methyl]propan-1-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C20H24N2O/c1-3-11-22(2)14-17-13-21-20-10-9-18(12-19(17)20)23-15-16-7-5-4-6-8-16/h4-10,12-13,21H,3,11,14-15H2,1-2H3 |
InChIKey | InChI | 1.06 | IWUWPBUWKVJQPU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCN(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12 |
SMILES | CACTVS | 3.385 | CCCN(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCN(C)Cc1c[nH]c2c1cc(cc2)OCc3ccccc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCN(C)Cc1c[nH]c2c1cc(cc2)OCc3ccccc3 |